COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.807  -2.630  -0.570  1.00  0.00           O  
HETATM    2  C   UNL     1      -5.584  -1.558  -0.031  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.767  -0.475  -1.095  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.955  -2.087   0.398  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.864  -0.966   1.182  1.00  0.00           C  
HETATM    6  N   UNL     1      -3.605  -0.353   0.751  1.00  0.00           N  
HETATM    7  C   UNL     1      -3.455   0.944   0.359  1.00  0.00           C  
HETATM    8  N   UNL     1      -4.278   1.985   0.239  1.00  0.00           N  
HETATM    9  C   UNL     1      -3.832   3.149  -0.178  1.00  0.00           C  
HETATM   10  N   UNL     1      -2.566   3.356  -0.496  1.00  0.00           N  
HETATM   11  C   UNL     1      -1.668   2.380  -0.410  1.00  0.00           C  
HETATM   12  N   UNL     1      -0.346   2.602  -0.744  1.00  0.00           N  
HETATM   13  N   UNL     1      -2.370  -1.006   0.684  1.00  0.00           N  
HETATM   14  C   UNL     1      -1.448  -0.174   0.260  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.097   1.117   0.031  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.013  -0.484   0.055  1.00  0.00           C  
HETATM   17  C   UNL     1       0.951   0.395   0.515  1.00  0.00           C  
HETATM   18  C   UNL     1       2.307   0.097   0.318  1.00  0.00           C  
HETATM   19  C   UNL     1       2.669  -1.102  -0.349  1.00  0.00           C  
HETATM   20  C   UNL     1       1.664  -1.975  -0.803  1.00  0.00           C  
HETATM   21  C   UNL     1       0.356  -1.671  -0.599  1.00  0.00           C  
HETATM   22  C   UNL     1       3.316   0.967   0.771  1.00  0.00           C  
HETATM   23  C   UNL     1       4.622   0.652   0.565  1.00  0.00           C  
HETATM   24  C   UNL     1       4.981  -0.530  -0.092  1.00  0.00           C  
HETATM   25  C   UNL     1       4.028  -1.398  -0.544  1.00  0.00           C  
HETATM   26  O   UNL     1       6.294  -0.818  -0.283  1.00  0.00           O  
HETATM   27  C   UNL     1       7.246   0.057   0.326  1.00  0.00           C  
HETATM   28  C   UNL     1       8.432   0.515  -0.525  1.00  0.00           C  
HETATM   29  C   UNL     1       8.644  -0.500   0.600  1.00  0.00           C  
HETATM   30  H   UNL     1      -5.205  -3.053  -1.343  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.280  -0.897  -1.959  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.359   0.343  -0.684  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.791  -0.098  -1.401  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.825  -2.859   1.157  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.547  -1.270   0.809  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.468  -2.510  -0.466  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.496  -0.209   1.646  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.655  -1.756   1.903  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.528   3.970  -0.264  1.00  0.00           H  
HETATM   40  H   UNL     1       0.236   1.852  -0.943  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.001   3.507  -0.780  1.00  0.00           H  
HETATM   42  H   UNL     1       0.661   1.305   1.020  1.00  0.00           H  
HETATM   43  H   UNL     1       1.932  -2.889  -1.312  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.409  -2.348  -0.947  1.00  0.00           H  
HETATM   45  H   UNL     1       3.053   1.883   1.279  1.00  0.00           H  
HETATM   46  H   UNL     1       5.393   1.323   0.913  1.00  0.00           H  
HETATM   47  H   UNL     1       4.318  -2.307  -1.050  1.00  0.00           H  
HETATM   48  H   UNL     1       6.838   0.768   1.045  1.00  0.00           H  
HETATM   49  H   UNL     1       8.486   0.148  -1.551  1.00  0.00           H  
HETATM   50  H   UNL     1       8.804   1.527  -0.368  1.00  0.00           H  
HETATM   51  H   UNL     1       9.157  -0.156   1.498  1.00  0.00           H  
HETATM   52  H   UNL     1       8.839  -1.534   0.314  1.00  0.00           H  
CONECT    1    2   30                                                 
CONECT    2    4    1    5    3                                       
CONECT    3    2   31   32   33                                       
CONECT    4    2   34   35   36                                       
CONECT    5    6    2   37   38                                       
CONECT    6   13    7    5                                            
CONECT    7   15    6    8    8                                       
CONECT    8    7    7    9                                            
CONECT    9   10   10    8   39                                       
CONECT   10   11    9    9                                            
CONECT   11   12   15   15   10                                       
CONECT   12   11   40   41                                            
CONECT   13   14   14    6                                            
CONECT   14   16   15   13   13                                       
CONECT   15   11   11   14    7                                       
CONECT   16   17   14   21   21                                       
CONECT   17   18   18   16   42                                       
CONECT   18   22   17   17   19                                       
CONECT   19   18   25   20   20                                       
CONECT   20   19   19   21   43                                       
CONECT   21   16   16   20   44                                       
CONECT   22   23   23   18   45                                       
CONECT   23   22   22   24   46                                       
CONECT   24   23   26   25   25                                       
CONECT   25   24   24   19   47                                       
CONECT   26   24   27                                                 
CONECT   27   26   29   28   48                                       
CONECT   28   27   29   49   50                                       
CONECT   29   27   28   51   52                                       
CONECT   30    1                                                      
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    9                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   17                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
CONECT   46   23                                                      
CONECT   47   25                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
CONECT   52   29                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
